N-[1-(4-cyanophenyl)-5-ethyl-pyrazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[1-(4-cyanophenyl)-5-ethyl-pyrazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[1-(4-cyanophenyl)-5-ethyl-pyrazol-3-yl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[1-(4-cyanophenyl)-5-ethyl-3-pyrazolyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[1-(4-cyanophenyl)-5-ethylpyrazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[1-(4-cyanophenyl)-5-ethyl-pyrazol-3-yl]-3-methyl-coumarilamide Formula: C22H18N4O2 MolecularWeight: 370.40392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=CC=C(C=C2)C#N)NC(=O)C3=C(C4=CC=CC=C4O3)C

Isomeric SMILES

CCC1=CC(=NN1C2=CC=C(C=C2)C#N)NC(=O)C3=C(C4=CC=CC=C4O3)C

InChI

InChI=1S/C22H18N4O2/c1-3-16-12-20(25-26(16)17-10-8-15(13-23)9-11-17)24-22(27)21-14(2)18-6-4-5-7-19(18)28-21/h4-12H,3H2,1-2H3,(H,24,25,27)